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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02446939

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.77
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.77
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.77
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.77
2MCMETHACRYLYL-COENZYME AA,B,C,D1RX00.71
2CP2-CARBOXYPROPYL-COENZYME AA1EF90.71
2CP2-CARBOXYPROPYL-COENZYME AA,B,C,D7REQ0.71
2BAA3C210.72
2BAA3C1Y0.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.76
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
B1U1P0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
A,B,C,D,E,F2IBS0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
B1U1R0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
R,S1U1Y0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
A,B,C,D,E,F2IBT0.72
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.77
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.77
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.77
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.77
3AD3'-DEOXYADENOSINEA,B3B4B0.79
3AD3'-DEOXYADENOSINEA,B3B4C0.79
3AD3'-DEOXYADENOSINEA,B1FA00.79
103A,B,C1CUL0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.72
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C3GGS0.77
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A1Z340.77
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C1PKE0.77
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A3C0I0.77
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A,B3C0G0.77
12A2-METHYLTHIO-N6-(AMINOCARBONYL-
L-THREONYL)-ADENOSINE-5'-MONOPHOSPHATE
A1FIR0.73
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B1GAG0.77
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
B,C2G2F0.77
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,C,D,E,F,
G,H
2G1T0.77
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B2GS60.77
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,E,F1RQQ0.77
2VA2'-(L-VALYL)AMINO-2'-DEOXYADENOSINEA1WNZ0.72
101A,B,C1CS40.76
26A6N-DIMETHYLADENOSINEA2A9Y0.82
26A6N-DIMETHYLADENOSINEA2A9Z0.82
2BUA1U6C0.75
2BUA1U6O0.75
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A1Z350.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A2PKK0.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C,D2ZJ00.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C1PK90.79